1,6-dimethylpyrimidine-2,4-dione

C6H8N2O2 — CID 10606818

IUPAC1,6-dimethylpyrimidine-2,4-dione
SMILESCc1cc(=O)[nH]c(=O)n1C
InChIInChI=1S/C6H8N2O2/c1-4-3-5(9)7-6(10)8(4)2/h3H,1-2H3,(H,7,9,10)
InChIKeyOCUWGDBSGJMUNG-UHFFFAOYSA-N
MW140.14 g/mol
LogP-0.62
Rot. Bonds

About 1,6-dimethylpyrimidine-2,4-dione

1,6-dimethylpyrimidine-2,4-dione (PubChem CID 10606818) has the molecular formula C6H8N2O2 and a molecular weight of 140.14 g/mol. Its IUPAC name is 1,6-dimethylpyrimidine-2,4-dione.

Molecular Properties

Compound Name1,6-dimethylpyrimidine-2,4-dione
PubChem CID10606818
Molecular FormulaC6H8N2O2
Molecular Weight140.14 g/mol
Exact Mass140.06
IUPAC Name1,6-dimethylpyrimidine-2,4-dione
SMILESCc1cc(=O)[nH]c(=O)n1C
InChIInChI=1S/C6H8N2O2/c1-4-3-5(9)7-6(10)8(4)2/h3H,1-2H3,(H,7,9,10)
InChIKeyOCUWGDBSGJMUNG-UHFFFAOYSA-N
XLogP-0.62
TPSA54.86 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.14
LogP ≤ 5-0.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-Methyluracil
CID 12283
6-Amino-1,3-dimethyluracil
CID 81152
3,5,6-Trimethyluracil
CID 98786
3-sec-Butyl-6-methyluracil
CID 100019
6-Amino-1-methyluracil
CID 75520
6-Amino-1-propyluracil
CID 104562
6-Amino-1-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 853899
1,3,6-Trimethyl-2,4(1H,3H)-pyrimidinedione
CID 26075
3-(2-Hydroxyethyl)-6-methyluracil
CID 2802244
2,4(1H,3H)-Pyrimidinedione, 3,6-dimethyl-
CID 88193
5-Amino-3,6-dimethylpyrimidine-2,4(1H,3H)-dione
CID 57357509
6-Ethylamino-1,3-dimethyl-1H-pyrimidine-2,4-dione
CID 652709

Frequently Asked Questions

What is the IUPAC name of 1,6-dimethylpyrimidine-2,4-dione?
The IUPAC name of 1,6-dimethylpyrimidine-2,4-dione (CID 10606818) is 1,6-dimethylpyrimidine-2,4-dione.
What is the SMILES notation for 1,6-dimethylpyrimidine-2,4-dione?
The canonical SMILES for 1,6-dimethylpyrimidine-2,4-dione is Cc1cc(=O)[nH]c(=O)n1C.
What is the InChIKey of 1,6-dimethylpyrimidine-2,4-dione?
The InChIKey is OCUWGDBSGJMUNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O2/c1-4-3-5(9)7-6(10)8(4)2/h3H,1-2H3,(H,7,9,10).
What are the key properties of 1,6-dimethylpyrimidine-2,4-dione?
1,6-dimethylpyrimidine-2,4-dione has a molecular weight of 140.14 g/mol, XLogP of -0.62, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethylpyrimidine-2,4-dione is sourced from PubChem (CID 10606818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).